Structure Info
- Chemspace ID
- CSSB06256034042 (In-Stock Building Blocks)
- CAS
- 2703780-93-0
- MFCD
- MFCD34550732
- IUPAC Name
- ethyl 1-(iodomethyl)-3-(2-phenyl-2H-1,2,3-triazol-4-yl)-2-oxabicyclo[2.2.2]octane-4-carboxylate
- Mol formula
- C19H22IN3O3
- Mol weight
- 467 Da
- Catalog Number(s)
- ArZ-UP354725, EN300-33041454
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.49
- Heavy atoms count
- 26
- Rotatable bond count
- 6
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.526
- Polar surface area (Å)
- 66
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSSB06256034042
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